Home Nitriles 2,2-dimethyltetrahydro-2H-pyran-4-carbonitrile

2,2-dimethyltetrahydro-2H-pyran-4-carbonitrile

CAS No.:
60549-63-5
Catalog Number:
AG00EDV4
Molecular Formula:
C8H13NO
Molecular Weight:
139.1949
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG00EDV4
Chemical Name:
2,2-dimethyltetrahydro-2H-pyran-4-carbonitrile
CAS Number:
60549-63-5
Molecular Formula:
C8H13NO
Molecular Weight:
139.1949
MDL Number:
MFCD11054007
IUPAC Name:
2,2-dimethyloxane-4-carbonitrile
InChI:
InChI=1S/C8H13NO/c1-8(2)5-7(6-9)3-4-10-8/h7H,3-5H2,1-2H3
InChI Key:
AEXZSVDYGIOBAK-UHFFFAOYSA-N
SMILES:
N#CC1CCOC(C1)(C)C
Properties
Complexity:
165  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
139.1g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
139.198g/mol
Monoisotopic Mass:
139.1g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
33A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Properties